Geometry & MOs

Info

ID:	402826
PubChem CID:	135057433
Reduced:	OF2H14C16 (1)
Stoich.:	AB2C14D16 (1)
Weight, g/mol:	448.139862
ΔH_f, kcal/mol:	-100.96
Dipole, Da:	1.96
IP(EA), eV:	-9.57(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-oxo-3-phenylpropyl)-N-quinolin-8-yl-6-(trifluoromethyl)benzamide

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)F)C2=C(C=CC(=C2)F)C(=O)C

DOS

IR

Vibrations